E022-0625 Screening compound: 2-{1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxopropan-2-yl}-2,3-dihydro-1,2-benzothiazol-3-one

E022-0625 Screening compound: 2-{1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxopropan-2-yl}-2,3-dihydro-1,2-benzothiazol-3-one
E022-0625 Screening compound: 2-{1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxopropan-2-yl}-2,3-dihydro-1,2-benzothiazol-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E022-0625
2-{1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxopropan-2-yl}-2,3-dihydro-1,2-benzothiazol-3-one

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

E022-0625

Molecular Formula

C20H20ClN3O2S (C20 H20 ClN3 O2 S)

Compound Name

2-{1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxopropan-2-yl}-2,3-dihydro-1,2-benzothiazol-3-one

IUPAC name

2-{1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxopropan-2-yl}-23-dihydro-12-benzothiazol-3-one

SMILES

CC(C(N(CC1)CCN1c1cccc(Cl)c1)=O)N1Sc(cccc2)c2C1=O

InChI

InChI=1S/C20H20ClN3O2S/c1-14(24-20(26)17-7-2-3-8-18(17)27-24)19(25)23-11-9-22(10-12-23)16-6-4-5-15(21)13-16/h2-8,13-14H,9-12H2,1H3/t14-/m0/s1

InChI Key

GLOQOCJOMDLGCU-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD14840521

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.92

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.457

Distribution Coefficient, logD

3.457

Water Solubility, LogSw

-3.71

Polar Surface Area

36.708

Acid Dissociation Constant (pKa)

20.33

Base Dissociation Constant (pKb)

2.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

E022-0625 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-Aging Library (44940 compounds)

Antifungal Library (16415 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with E022-0625 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E022-0625?
Check Price and Availability of E022-0625, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E022-0625 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E022-0625
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E022-0625
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of E022-0625 available by request